4-methoxy-2,5-dimethyl-N-[(2S)-2-(phenylsulfonyl)-2-pyridin-3-yl-ethyl]benzenesulfonamide

Systemtic Name: 4-methoxy-2,5-dimethyl-N-[(2S)-2-(phenylsulfonyl)-2-pyridin-3-yl-ethyl]benzenesulfonamide Openeye Name: N-[(2S)-2-(benzenesulfonyl)-2-(3-pyridyl)ethyl]-4-methoxy-2,5-dimethyl-benzenesulfonamide CAS Name: N-[(2S)-2-(benzenesulfonyl)-2-(3-pyridinyl)ethyl]-4-methoxy-2,5-dimethylbenzenesulfonamide IUPAC Name: N-[(2S)-2-(benzenesulfonyl)-2-pyridin-3-ylethyl]-4-methoxy-2,5-dimethylbenzenesulfonamide Traditional Name: N-[(2S)-2-besyl-2-(3-pyridyl)ethyl]-4-methoxy-2,5-dimethyl-benzenesulfonamide Formula: C22H24N2O5S2 MolecularWeight: 460.56636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1S(=O)(=O)NCC(C2=CN=CC=C2)S(=O)(=O)C3=CC=CC=C3)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1S(=O)(=O)NC[C@H](C2=CN=CC=C2)S(=O)(=O)C3=CC=CC=C3)C)OC

InChI

InChI=1S/C22H24N2O5S2/c1-16-13-21(17(2)12-20(16)29-3)31(27,28)24-15-22(18-8-7-11-23-14-18)30(25,26)19-9-5-4-6-10-19/h4-14,22,24H,15H2,1-3H3/t22-/m1/s1